ChemSpider 2D Image | Diethyl (6-methoxy-3-nitro-2-pyridinyl)malonate | C13H16N2O7

Diethyl (6-methoxy-3-nitro-2-pyridinyl)malonate

  • Molecular FormulaC13H16N2O7
  • Average mass312.275 Da
  • Monoisotopic mass312.095764 Da
  • ChemSpider ID14419383

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(6-Méthoxy-3-nitro-2-pyridinyl)malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl (6-methoxy-3-nitro-2-pyridinyl)malonate [ACD/IUPAC Name]
Diethyl-(6-methoxy-3-nitro-2-pyridinyl)malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(6-methoxy-3-nitro-2-pyridinyl)-, diethyl ester [ACD/Index Name]
1000342-55-1 [RN]
2-(2'-Diethyl Malonate)-6-methoxy-3-nitropyridine
Diethyl 2-(6-methoxy-3-nitropyridin-2-yl)malonate
MFCD09880022

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 424.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 210.6±28.7 °C
Index of Refraction: 1.523
Molar Refractivity: 73.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 13.58
ACD/KOC (pH 5.5): 223.83
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.02
ACD/KOC (pH 7.4): 181.73
Polar Surface Area: 121 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 241.6±3.0 cm3

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